3-dibenzothiophen-2-yl-9-(7,7-dimethylfluoreno[5,6-b][1]benzofuran-9-yl)-6-phenylcarbazole;3-dibenzothiophen-2-yl-9-(12,12-dimethylfluoreno[2,1-b][1]benzofuran-10-yl)-6-phenylcarbazole;3-dibenzothiophen-4-yl-9-(7,7-dimethylfluoreno[5,6-b][1]benzofuran-9-yl)-6-phenylcarbazole;3-dibenzothiophen-4-yl-9-(7,7-dimethylfluoreno[5,6-b][1]benzothiol-9-yl)-6-phenylcarbazole

C204H132N4O3S5 — CID 157299796

IUPAC3-dibenzothiophen-2-yl-9-(7,7-dimethylfluoreno[5,6-b][1]benzofuran-9-yl)-6-phenylcarbazole;3-dibenzothiophen-2-yl-9-(12,12-dimethylfluoreno[2,1-b][1]benzofuran-10-yl)-6-phenylcarbazole;3-dibenzothiophen-4-yl-9-(7,7-dimethylfluoreno[5,6-b][1]benzofuran-9-yl)-6-phenylcarbazole;3-dibenzothiophen-4-yl-9-(7,7-dimethylfluoreno[5,6-b][1]benzothiol-9-yl)-6-phenylcarbazole
SMILESCC1(C)c2cc(-n3c4ccc(-c5ccccc5)cc4c4cc(-c5ccc6sc7ccccc7c6c5)ccc43)ccc2-c2c1ccc1c2oc2ccccc21.CC1(C)c2cc(-n3c4ccc(-c5ccccc5)cc4c4cc(-c5ccc6sc7ccccc7c6c5)ccc43)ccc2-c2ccc3oc4ccccc4c3c21.CC1(C)c2cc(-n3c4ccc(-c5ccccc5)cc4c4cc(-c5cccc6c5sc5ccccc56)ccc43)ccc2-c2c1ccc1c2oc2ccccc21.CC1(C)c2cc(-n3c4ccc(-c5ccccc5)cc4c4cc(-c5cccc6c5sc5ccccc56)ccc43)ccc2-c2c1ccc1c2sc2ccccc21
InChIInChI=1S/3C51H33NOS.C51H33NS2/c1-51(2)42-24-23-37-35-13-6-8-17-46(35)53-49(37)48(42)39-22-21-33(29-43(39)51)52-44-25-19-31(30-11-4-3-5-12-30)27-40(44)41-28-32(20-26-45(41)52)34-15-10-16-38-36-14-7-9-18-47(36)54-50(34)38;1-51(2)42-29-34(19-20-35(42)37-21-24-46-49(50(37)51)38-13-6-8-14-45(38)53-46)52-43-22-16-31(30-10-4-3-5-11-30)26-39(43)40-27-32(17-23-44(40)52)33-18-25-48-41(28-33)36-12-7-9-15-47(36)54-48;1-51(2)42-22-21-37-35-12-6-8-14-46(35)53-50(37)49(42)38-20-19-34(29-43(38)51)52-44-23-16-31(30-10-4-3-5-11-30)26-39(44)40-27-32(17-24-45(40)52)33-18-25-48-41(28-33)36-13-7-9-15-47(36)54-48;1-51(2)42-24-23-38-36-14-7-9-18-47(36)54-50(38)48(42)39-22-21-33(29-43(39)51)52-44-25-19-31(30-11-4-3-5-12-30)27-40(44)41-28-32(20-26-45(41)52)34-15-10-16-37-35-13-6-8-17-46(35)53-49(34)37/h4*3-29H,1-2H3
InChIKeyBBTOSVFZKMHJBC-UHFFFAOYSA-N
MW2847.66 g/mol
LogP59.23
Rot. Bonds12

About 3-dibenzothiophen-2-yl-9-(7,7-dimethylfluoreno[5,6-b][1]benzofuran-9-yl)-6-phenylcarbazole;3-dibenzothiophen-2-yl-9-(12,12-dimethylfluoreno[2,1-b][1]benzofuran-10-yl)-6-phenylcarbazole;3-dibenzothiophen-4-yl-9-(7,7-dimethylfluoreno[5,6-b][1]benzofuran-9-yl)-6-phenylcarbazole;3-dibenzothiophen-4-yl-9-(7,7-dimethylfluoreno[5,6-b][1]benzothiol-9-yl)-6-phenylcarbazole

3-dibenzothiophen-2-yl-9-(7,7-dimethylfluoreno[5,6-b][1]benzofuran-9-yl)-6-phenylcarbazole;3-dibenzothiophen-2-yl-9-(12,12-dimethylfluoreno[2,1-b][1]benzofuran-10-yl)-6-phenylcarbazole;3-dibenzothiophen-4-yl-9-(7,7-dimethylfluoreno[5,6-b][1]benzofuran-9-yl)-6-phenylcarbazole;3-dibenzothiophen-4-yl-9-(7,7-dimethylfluoreno[5,6-b][1]benzothiol-9-yl)-6-phenylcarbazole (PubChem CID 157299796) has the molecular formula C204H132N4O3S5 and a molecular weight of 2847.66 g/mol. Its IUPAC name is 3-dibenzothiophen-2-yl-9-(7,7-dimethylfluoreno[5,6-b][1]benzofuran-9-yl)-6-phenylcarbazole;3-dibenzothiophen-2-yl-9-(12,12-dimethylfluoreno[2,1-b][1]benzofuran-10-yl)-6-phenylcarbazole;3-dibenzothiophen-4-yl-9-(7,7-dimethylfluoreno[5,6-b][1]benzofuran-9-yl)-6-phenylcarbazole;3-dibenzothiophen-4-yl-9-(7,7-dimethylfluoreno[5,6-b][1]benzothiol-9-yl)-6-phenylcarbazole.

Molecular Properties

Compound Name3-dibenzothiophen-2-yl-9-(7,7-dimethylfluoreno[5,6-b][1]benzofuran-9-yl)-6-phenylcarbazole;3-dibenzothiophen-2-yl-9-(12,12-dimethylfluoreno[2,1-b][1]benzofuran-10-yl)-6-phenylcarbazole;3-dibenzothiophen-4-yl-9-(7,7-dimethylfluoreno[5,6-b][1]benzofuran-9-yl)-6-phenylcarbazole;3-dibenzothiophen-4-yl-9-(7,7-dimethylfluoreno[5,6-b][1]benzothiol-9-yl)-6-phenylcarbazole
PubChem CID157299796
Molecular FormulaC204H132N4O3S5
Molecular Weight2847.66 g/mol
Exact Mass2844.89
IUPAC Name3-dibenzothiophen-2-yl-9-(7,7-dimethylfluoreno[5,6-b][1]benzofuran-9-yl)-6-phenylcarbazole;3-dibenzothiophen-2-yl-9-(12,12-dimethylfluoreno[2,1-b][1]benzofuran-10-yl)-6-phenylcarbazole;3-dibenzothiophen-4-yl-9-(7,7-dimethylfluoreno[5,6-b][1]benzofuran-9-yl)-6-phenylcarbazole;3-dibenzothiophen-4-yl-9-(7,7-dimethylfluoreno[5,6-b][1]benzothiol-9-yl)-6-phenylcarbazole
SMILESCC1(C)c2cc(-n3c4ccc(-c5ccccc5)cc4c4cc(-c5ccc6sc7ccccc7c6c5)ccc43)ccc2-c2c1ccc1c2oc2ccccc21.CC1(C)c2cc(-n3c4ccc(-c5ccccc5)cc4c4cc(-c5ccc6sc7ccccc7c6c5)ccc43)ccc2-c2ccc3oc4ccccc4c3c21.CC1(C)c2cc(-n3c4ccc(-c5ccccc5)cc4c4cc(-c5cccc6c5sc5ccccc56)ccc43)ccc2-c2c1ccc1c2oc2ccccc21.CC1(C)c2cc(-n3c4ccc(-c5ccccc5)cc4c4cc(-c5cccc6c5sc5ccccc56)ccc43)ccc2-c2c1ccc1c2sc2ccccc21
InChIInChI=1S/3C51H33NOS.C51H33NS2/c1-51(2)42-24-23-37-35-13-6-8-17-46(35)53-49(37)48(42)39-22-21-33(29-43(39)51)52-44-25-19-31(30-11-4-3-5-12-30)27-40(44)41-28-32(20-26-45(41)52)34-15-10-16-38-36-14-7-9-18-47(36)54-50(34)38;1-51(2)42-29-34(19-20-35(42)37-21-24-46-49(50(37)51)38-13-6-8-14-45(38)53-46)52-43-22-16-31(30-10-4-3-5-11-30)26-39(43)40-27-32(17-23-44(40)52)33-18-25-48-41(28-33)36-12-7-9-15-47(36)54-48;1-51(2)42-22-21-37-35-12-6-8-14-46(35)53-50(37)49(42)38-20-19-34(29-43(38)51)52-44-23-16-31(30-10-4-3-5-11-30)26-39(44)40-27-32(17-24-45(40)52)33-18-25-48-41(28-33)36-13-7-9-15-47(36)54-48;1-51(2)42-24-23-38-36-14-7-9-18-47(36)54-50(38)48(42)39-22-21-33(29-43(39)51)52-44-25-19-31(30-11-4-3-5-12-30)27-40(44)41-28-32(20-26-45(41)52)34-15-10-16-37-35-13-6-8-17-46(35)53-49(34)37/h4*3-29H,1-2H3
InChIKeyBBTOSVFZKMHJBC-UHFFFAOYSA-N
XLogP59.23
TPSA59.14 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds12
Heavy Atoms216
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002847.66
LogP ≤ 559.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Analyze 3-dibenzothiophen-2-yl-9-(7,7-dimethylfluoreno[5,6-b][1]benzofuran-9-yl)-6-phenylcarbazole;3-dibenzothiophen-2-yl-9-(12,12-dimethylfluoreno[2,1-b][1]benzofuran-10-yl)-6-phenylcarbazole;3-dibenzothiophen-4-yl-9-(7,7-dimethylfluoreno[5,6-b][1]benzofuran-9-yl)-6-phenylcarbazole;3-dibenzothiophen-4-yl-9-(7,7-dimethylfluoreno[5,6-b][1]benzothiol-9-yl)-6-phenylcarbazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 3-dibenzothiophen-2-yl-9-(7,7-dimethylfluoreno[5,6-b][1]benzofuran-9-yl)-6-phenylcarbazole;3-dibenzothiophen-2-yl-9-(12,12-dimethylfluoreno[2,1-b][1]benzofuran-10-yl)-6-phenylcarbazole;3-dibenzothiophen-4-yl-9-(7,7-dimethylfluoreno[5,6-b][1]benzofuran-9-yl)-6-phenylcarbazole;3-dibenzothiophen-4-yl-9-(7,7-dimethylfluoreno[5,6-b][1]benzothiol-9-yl)-6-phenylcarbazole?
The IUPAC name of 3-dibenzothiophen-2-yl-9-(7,7-dimethylfluoreno[5,6-b][1]benzofuran-9-yl)-6-phenylcarbazole;3-dibenzothiophen-2-yl-9-(12,12-dimethylfluoreno[2,1-b][1]benzofuran-10-yl)-6-phenylcarbazole;3-dibenzothiophen-4-yl-9-(7,7-dimethylfluoreno[5,6-b][1]benzofuran-9-yl)-6-phenylcarbazole;3-dibenzothiophen-4-yl-9-(7,7-dimethylfluoreno[5,6-b][1]benzothiol-9-yl)-6-phenylcarbazole (CID 157299796) is 3-dibenzothiophen-2-yl-9-(7,7-dimethylfluoreno[5,6-b][1]benzofuran-9-yl)-6-phenylcarbazole;3-dibenzothiophen-2-yl-9-(12,12-dimethylfluoreno[2,1-b][1]benzofuran-10-yl)-6-phenylcarbazole;3-dibenzothiophen-4-yl-9-(7,7-dimethylfluoreno[5,6-b][1]benzofuran-9-yl)-6-phenylcarbazole;3-dibenzothiophen-4-yl-9-(7,7-dimethylfluoreno[5,6-b][1]benzothiol-9-yl)-6-phenylcarbazole.
What is the SMILES notation for 3-dibenzothiophen-2-yl-9-(7,7-dimethylfluoreno[5,6-b][1]benzofuran-9-yl)-6-phenylcarbazole;3-dibenzothiophen-2-yl-9-(12,12-dimethylfluoreno[2,1-b][1]benzofuran-10-yl)-6-phenylcarbazole;3-dibenzothiophen-4-yl-9-(7,7-dimethylfluoreno[5,6-b][1]benzofuran-9-yl)-6-phenylcarbazole;3-dibenzothiophen-4-yl-9-(7,7-dimethylfluoreno[5,6-b][1]benzothiol-9-yl)-6-phenylcarbazole?
The canonical SMILES for 3-dibenzothiophen-2-yl-9-(7,7-dimethylfluoreno[5,6-b][1]benzofuran-9-yl)-6-phenylcarbazole;3-dibenzothiophen-2-yl-9-(12,12-dimethylfluoreno[2,1-b][1]benzofuran-10-yl)-6-phenylcarbazole;3-dibenzothiophen-4-yl-9-(7,7-dimethylfluoreno[5,6-b][1]benzofuran-9-yl)-6-phenylcarbazole;3-dibenzothiophen-4-yl-9-(7,7-dimethylfluoreno[5,6-b][1]benzothiol-9-yl)-6-phenylcarbazole is CC1(C)c2cc(-n3c4ccc(-c5ccccc5)cc4c4cc(-c5ccc6sc7ccccc7c6c5)ccc43)ccc2-c2c1ccc1c2oc2ccccc21.CC1(C)c2cc(-n3c4ccc(-c5ccccc5)cc4c4cc(-c5ccc6sc7ccccc7c6c5)ccc43)ccc2-c2ccc3oc4ccccc4c3c21.CC1(C)c2cc(-n3c4ccc(-c5ccccc5)cc4c4cc(-c5cccc6c5sc5ccccc56)ccc43)ccc2-c2c1ccc1c2oc2ccccc21.CC1(C)c2cc(-n3c4ccc(-c5ccccc5)cc4c4cc(-c5cccc6c5sc5ccccc56)ccc43)ccc2-c2c1ccc1c2sc2ccccc21.
What is the InChIKey of 3-dibenzothiophen-2-yl-9-(7,7-dimethylfluoreno[5,6-b][1]benzofuran-9-yl)-6-phenylcarbazole;3-dibenzothiophen-2-yl-9-(12,12-dimethylfluoreno[2,1-b][1]benzofuran-10-yl)-6-phenylcarbazole;3-dibenzothiophen-4-yl-9-(7,7-dimethylfluoreno[5,6-b][1]benzofuran-9-yl)-6-phenylcarbazole;3-dibenzothiophen-4-yl-9-(7,7-dimethylfluoreno[5,6-b][1]benzothiol-9-yl)-6-phenylcarbazole?
The InChIKey is BBTOSVFZKMHJBC-UHFFFAOYSA-N. The full InChI is InChI=1S/3C51H33NOS.C51H33NS2/c1-51(2)42-24-23-37-35-13-6-8-17-46(35)53-49(37)48(42)39-22-21-33(29-43(39)51)52-44-25-19-31(30-11-4-3-5-12-30)27-40(44)41-28-32(20-26-45(41)52)34-15-10-16-38-36-14-7-9-18-47(36)54-50(34)38;1-51(2)42-29-34(19-20-35(42)37-21-24-46-49(50(37)51)38-13-6-8-14-45(38)53-46)52-43-22-16-31(30-10-4-3-5-11-30)26-39(43)40-27-32(17-23-44(40)52)33-18-25-48-41(28-33)36-12-7-9-15-47(36)54-48;1-51(2)42-22-21-37-35-12-6-8-14-46(35)53-50(37)49(42)38-20-19-34(29-43(38)51)52-44-23-16-31(30-10-4-3-5-11-30)26-39(44)40-27-32(17-24-45(40)52)33-18-25-48-41(28-33)36-13-7-9-15-47(36)54-48;1-51(2)42-24-23-38-36-14-7-9-18-47(36)54-50(38)48(42)39-22-21-33(29-43(39)51)52-44-25-19-31(30-11-4-3-5-12-30)27-40(44)41-28-32(20-26-45(41)52)34-15-10-16-37-35-13-6-8-17-46(35)53-49(34)37/h4*3-29H,1-2H3.
What are the key properties of 3-dibenzothiophen-2-yl-9-(7,7-dimethylfluoreno[5,6-b][1]benzofuran-9-yl)-6-phenylcarbazole;3-dibenzothiophen-2-yl-9-(12,12-dimethylfluoreno[2,1-b][1]benzofuran-10-yl)-6-phenylcarbazole;3-dibenzothiophen-4-yl-9-(7,7-dimethylfluoreno[5,6-b][1]benzofuran-9-yl)-6-phenylcarbazole;3-dibenzothiophen-4-yl-9-(7,7-dimethylfluoreno[5,6-b][1]benzothiol-9-yl)-6-phenylcarbazole?
3-dibenzothiophen-2-yl-9-(7,7-dimethylfluoreno[5,6-b][1]benzofuran-9-yl)-6-phenylcarbazole;3-dibenzothiophen-2-yl-9-(12,12-dimethylfluoreno[2,1-b][1]benzofuran-10-yl)-6-phenylcarbazole;3-dibenzothiophen-4-yl-9-(7,7-dimethylfluoreno[5,6-b][1]benzofuran-9-yl)-6-phenylcarbazole;3-dibenzothiophen-4-yl-9-(7,7-dimethylfluoreno[5,6-b][1]benzothiol-9-yl)-6-phenylcarbazole has a molecular weight of 2847.66 g/mol, XLogP of 59.23, 12 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 3-dibenzothiophen-2-yl-9-(7,7-dimethylfluoreno[5,6-b][1]benzofuran-9-yl)-6-phenylcarbazole;3-dibenzothiophen-2-yl-9-(12,12-dimethylfluoreno[2,1-b][1]benzofuran-10-yl)-6-phenylcarbazole;3-dibenzothiophen-4-yl-9-(7,7-dimethylfluoreno[5,6-b][1]benzofuran-9-yl)-6-phenylcarbazole;3-dibenzothiophen-4-yl-9-(7,7-dimethylfluoreno[5,6-b][1]benzothiol-9-yl)-6-phenylcarbazole is sourced from PubChem (CID 157299796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).